3-fluoranyl-4-[5-(trifluoromethyl)pyridin-2-yl]sulfanyl-benzenecarbonitrile

Systemtic Name: 3-fluoranyl-4-[5-(trifluoromethyl)pyridin-2-yl]sulfanyl-benzenecarbonitrile Openeye Name: 3-fluoro-4-[[5-(trifluoromethyl)-2-pyridyl]sulfanyl]benzonitrile CAS Name: 3-fluoro-4-[[5-(trifluoromethyl)-2-pyridinyl]thio]benzonitrile IUPAC Name: 3-fluoro-4-[5-(trifluoromethyl)pyridin-2-yl]sulfanylbenzonitrile Traditional Name: 3-fluoro-4-[[5-(trifluoromethyl)-2-pyridyl]thio]benzonitrile Formula: C13H6F4N2S MolecularWeight: 298.258753

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C#N)F)SC2=NC=C(C=C2)C(F)(F)F

Isomeric SMILES

C1=CC(=C(C=C1C#N)F)SC2=NC=C(C=C2)C(F)(F)F

InChI

InChI=1S/C13H6F4N2S/c14-10-5-8(6-18)1-3-11(10)20-12-4-2-9(7-19-12)13(15,16)17/h1-5,7H